RefChem:319167
TL;DR: RefChem:319167 (CAS 64048-43-7) is a chemical compound with molecular formula C28H42N2O2S and molecular weight 470.2967 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzyl-dimethyl-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]azanium thiocyanate
Also Known As: Ammonium, benzyldimethyl(2-(2-(p-1,1,3,3-tetramethylbutylphenoxy)ethoxy)ethyl)-, thiocyanate, benzyl-dimethyl-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy, Ammonium thiocyanate, benzyldimethyl{2-[2-(p-1,1,3,3-tetramethylbutyl-phenoxy)ethoxy]ethyl}-, Benzenemethanaminium, N,N-dimethyl-N-[2-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]-, thiocyanate, benzyl-dimethyl-[2-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]ammonium; thiocyanic acid
Technical Specifications
| Molecular Formula | C28H42N2O2S |
| Molecular Weight | 470.2967 g/mol |
| XLogP | 6.09 |
| Topological Polar Surface Area (TPSA) | 43.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 470.2967 Da |
| Heavy Atoms | 33 |
| Complexity | 497.0 |
| SMILES | CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCOCC[N+](C)(C)CC2=CC=CC=C2.C(#N)[S-] |
| InChIKey | OGHTWVWGJZOCIQ-UHFFFAOYSA-M |
Chemical Property Profile of RefChem:319167
Property Insights of RefChem:319167
The XLogP value of 6.09 indicates that RefChem:319167 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.3 Ų, RefChem:319167 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:319167 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:319167?
The CAS number of RefChem:319167 is 64048-43-7.
What is the molecular formula of RefChem:319167?
The molecular formula of RefChem:319167 is C28H42N2O2S.
What is the molecular weight of RefChem:319167?
The molecular weight of RefChem:319167 is 470.2967 g/mol.
Where can I buy RefChem:319167?
You can request a quote for RefChem:319167 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:319167?
Yes, CoreyChem provides custom synthesis services for RefChem:319167 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.